Assignment w1 w2 S4H-N 115.678 8.105 K6H-N 123.865 9.54 Y7H-N 117.965 7.369 L9H-N 121.778 8.493 Q10H-N 123.418 8.547 Q10HE21-NE2 111.309 6.557 Q10HE22-NE2 111.309 7.071 L11H-N 122.2 8.599 Y12H-N 124.687 8.895 D13H-N 121.048 8.967 E14H-N 115.544 7.952 T15H-N 111.943 8.696 Y16H-N 113.682 9.5 E17H-N 107.851 8.176 R18H-N 117.31 6.21 G19H-N 105.542 8.236 S20H-N 115.059 8.421 Y21H-N 116.561 7.634 I22H-N 120.142 8.27 E23H-N 122.124 8.151 V24H-N 122.851 8.646 Y25H-N 121.901 9.213 K26H-N 118.179 7.806 S27H-N 114.618 8.504 V28H-N 123.783 9.674 G29H-N 114.439 8.698 S30H-N 111.121 7.075 L31H-N 129.3 7.875 S32H-N 116.223 8.018 W35H-N 123.172 8.486 W35HE1-NE1 128.664 10.057 T36H-N 112.037 9.04 G38H-N 106.544 8.873 S39H-N 110.671 7.937 V40H-N 118.184 8.117 C41H-N 121.149 9.394 V42H-N 120.837 8.432 F44H-N 122.126 8.588 V45H-N 132.39 10.599 N46H-N 126.445 7.713 N46HD21-ND2 112.796 7.741 N46HD22-ND2 112.796 7.023 D47H-N 119.579 7.571 K49H-N 121.863 8.235 R50H-N 118.576 8.009 E51H-N 118.815 8.12 R52H-N 122.767 8.539 Y54H-N 122.146 7.334 W55H-N 127.923 8.107 W55HE1-NE1 127.853 10.021 Y56H-N 118.016 9.342 L57H-N 120.874 9.091 F58H-N 117.27 8.538 D59H-N 120.405 8.553 N60H-N 119.678 8.064 N60HD21-ND2 112.725 7.644 N60HD22-ND2 112.725 6.93 V61H-N 113.961 8.682 N62H-N 115.68 9.419 N62HD21-ND2 112.669 7.387 N62HD22-ND2 112.669 6.694 Y63H-N 111.32 7.712 T64H-N 108.355 6.188 G65H-N 103.676 8.057 R66H-N 123.666 8.747 I67H-N 118.464 7.847 T68H-N 123.018 8.807 G69H-N 114.445 8.484 L70H-N 123.255 8.592 G71H-N 107.727 7.758 H72H-N 118.715 9.134 G73H-N 111.118 7.794 T74H-N 111.56 7.595 C75H-N 117.686 8.439 I76H-N 122.361 9.297 D77H-N 125.797 8.342 D78H-N 114.967 7.873 F79H-N 125.927 9.057 T80H-N 112.444 8.609 K81H-N 120.052 7.031 S82H-N 114.383 7.448 G83H-N 110.127 8.016 F84H-N 121.383 7.833 K85H-N 121.006 8.954 G86H-N 105.139 7.582 I87H-N 120.318 9.621 S88H-N 121.427 9.051 S89H-N 109.343 8.001 I90H-N 118.441 9.102 K91H-N 128.619 10.199 R92H-N 128.991 8.767 C93H-N 127.9 8.759 I94H-N 117.815 8.514 Q95H-N 123.836 9.232 Q95HE21-NE2 112.558 7.336 Q95HE22-NE2 112.558 7.07 T96H-N 118.262 9.077 D98H-N 116.0 7.974 G99H-N 108.249 8.148 K100H-N 122.59 7.42 V101H-N 123.781 8.362 E102H-N 128.008 9.101 C103H-N 118.703 8.55 I104H-N 122.626 8.537 Q106H-N 125.58 7.895 Q106HE21-NE2 112.42 7.506 Q106HE22-NE2 112.42 6.828